4-[2-[(5S)-2-(4-chloranyl-3-methyl-phenyl)imino-3-methyl-4-oxidanylidene-1,3-thiazolidin-5-yl]ethanoylamino]benzoate

Systemtic Name: 4-[2-[(5S)-2-(4-chloranyl-3-methyl-phenyl)imino-3-methyl-4-oxidanylidene-1,3-thiazolidin-5-yl]ethanoylamino]benzoate Openeye Name: 4-[[2-[(5S)-2-(4-chloro-3-methyl-phenyl)imino-3-methyl-4-oxo-thiazolidin-5-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[(5S)-2-(4-chloro-3-methylphenyl)imino-3-methyl-4-oxo-5-thiazolidinyl]-1-oxoethyl]amino]benzoate IUPAC Name: 4-[[2-[(5S)-2-(4-chloro-3-methylphenyl)imino-3-methyl-4-oxo-1,3-thiazolidin-5-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(5S)-2-(4-chloro-3-methyl-phenyl)imino-4-keto-3-methyl-thiazolidin-5-yl]acetyl]amino]benzoate Formula: C20H17ClN3O4S- MolecularWeight: 430.88468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N=C2N(C(=O)C(S2)CC(=O)NC3=CC=C(C=C3)C(=O)[O-])C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)N=C2N(C(=O)[C@@H](S2)CC(=O)NC3=CC=C(C=C3)C(=O)[O-])C)Cl

InChI

InChI=1S/C20H18ClN3O4S/c1-11-9-14(7-8-15(11)21)23-20-24(2)18(26)16(29-20)10-17(25)22-13-5-3-12(4-6-13)19(27)28/h3-9,16H,10H2,1-2H3,(H,22,25)(H,27,28)/p-1/t16-/m0/s1